Vitas-M small molecule compound

2-[(5E)-5-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-ethoxybenzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)acetamide

Catalog ID
STL379290
SMILES CCOc1cc(ccc1Oc1nc(Cl)ncc1F)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccccc1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H20ClFN4O5S MW 542.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN4O5S/c1-3-35-19-10-15(8-9-18(19)36-22-16(27)12-28-24(26)30-22)11-20-23(33)31(25(34)37-20)13-21(32)29-17-7-5-4-6-14(17)2/h4-12H,3,13H2,1-2H3,(H,29,32)/b20-11+
InChIKey
PGKSCKDOXTWZJK-RGVLZGJSSA-N
Synonyms

2((5E)5((4(2chloro5fluoropyrimidin4yl)oxy3ethoxyphenyl)methylidene)24dioxo13thiazolidin3yl)N(2methylphenyl)acetamide
2((5E)5(4((2chloro5fluoropyrimidin4yl)oxy)3ethoxybenzylidene)24dioxo13thiazolidin3yl)N(2methylphenyl)acetamide
2(5(4((2CHLORO5FLUORO4PYRIMIDINYL)OXY)3ETHOXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)N(2METHYLPHENYL)ACETAMIDE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)NC3=CC=CC=C3C)OC4=NC(=NC=C4F)Cl
CCOc1cc(ccc1Oc1nc(Cl)ncc1F)C=C1SC(=O)N(C1=O)CC(=O)Nc1ccccc1C
InChI=1SC25H20ClFN4O5Sc1335191015(8918(19)362216(27)122824(26)3022)112023(33)31(25(34)3720)1321(32)2917754614(17)2h412H313H212H3(H2932)b2011+
MFCD04091280
ZINC000008439131
ZINC08439131
ZINC8439131

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.